dicaesium(1+) ion oxotitaniumbis(olate)

• ChemBase ID: 303309
• Molecular Formular: Cs2O3Ti
• Molecular Mass: 361.6761
• Monoisotopic Mass: 361.74359216
• SMILES: [O-][Ti](=O)[O-].[Cs+].[Cs+]
• Canonical SMILES: [O-][Ti](=O)[O-].[Cs+].[Cs+]
• InChI: InChI=1S/2Cs.3O.Ti/q2*+1;;2*-1
• InChIKey: GQIPNNKRGFPONZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dicaesium(1+) ion oxotitaniumbis(olate)
• IUPAC Traditional name: dicaesium(1+) ion oxotitaniumbis(olate)
• Synonyms: Cesium titanate; Cesium titanium oxide; 钛酸铯

Database IDs

• CAS Number: 12158-57-5
• EC Number: 235-283-1
• MDL Number: MFCD00053969

CALCULATED PROPERTIES

• Acid pKa: 2.69897
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -3.578295
• LogD (pH = 7.4): -3.7371097
• Log P: -1.4238
• Molar Refractivity: 4.3287 cm^3
• Polarizability: 5.2817564 Å^3
• Polar Surface Area: 63.19 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: -100 Mesh Powder

Safety Information

• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37
• Safety Statements: 26
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Hazard statements: H319-H335
• GHS Precautionary statements: P261-P280-P305+P351+P338-P304+P340-P405-P501A

Product Information

• Purity: 99.85% (metals basis)